4-bromanyl-5-oxidanyl-2,3,4,5-tetrahydro-1-benzoxepine-7-carbonitrile

Systemtic Name: 4-bromanyl-5-oxidanyl-2,3,4,5-tetrahydro-1-benzoxepine-7-carbonitrile Openeye Name: 4-bromo-5-hydroxy-2,3,4,5-tetrahydro-1-benzoxepine-7-carbonitrile CAS Name: 4-bromo-5-hydroxy-2,3,4,5-tetrahydro-1-benzoxepin-7-carbonitrile IUPAC Name: 4-bromo-5-hydroxy-2,3,4,5-tetrahydro-1-benzoxepine-7-carbonitrile Traditional Name: 4-bromo-5-hydroxy-2,3,4,5-tetrahydro-1-benzoxepin-7-carbonitrile Formula: C11H10BrNO2 MolecularWeight: 268.1066

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C#N)C(C1Br)O

Isomeric SMILES

C1COC2=C(C=C(C=C2)C#N)C(C1Br)O

InChI

InChI=1S/C11H10BrNO2/c12-9-3-4-15-10-2-1-7(6-13)5-8(10)11(9)14/h1-2,5,9,11,14H,3-4H2